(2S,3S)-3-phenyl-2,3-dihydro-1H-indole-2-carboxamide

C15H14N2O — CID 100944790

IUPAC(2S,3S)-3-phenyl-2,3-dihydro-1H-indole-2-carboxamide
SMILESNC(=O)[C@H]1Nc2ccccc2[C@@H]1c1ccccc1
InChIInChI=1S/C15H14N2O/c16-15(18)14-13(10-6-2-1-3-7-10)11-8-4-5-9-12(11)17-14/h1-9,13-14,17H,(H2,16,18)/t13-,14-/m0/s1
InChIKeyMBYUEJUBZSXMSJ-KBPBESRZSA-N
MW238.29 g/mol
LogP2.10
Rot. Bonds2

About (2S,3S)-3-phenyl-2,3-dihydro-1H-indole-2-carboxamide

(2S,3S)-3-phenyl-2,3-dihydro-1H-indole-2-carboxamide (PubChem CID 100944790) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is (2S,3S)-3-phenyl-2,3-dihydro-1H-indole-2-carboxamide.

Molecular Properties

Compound Name(2S,3S)-3-phenyl-2,3-dihydro-1H-indole-2-carboxamide
PubChem CID100944790
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name(2S,3S)-3-phenyl-2,3-dihydro-1H-indole-2-carboxamide
SMILESNC(=O)[C@H]1Nc2ccccc2[C@@H]1c1ccccc1
InChIInChI=1S/C15H14N2O/c16-15(18)14-13(10-6-2-1-3-7-10)11-8-4-5-9-12(11)17-14/h1-9,13-14,17H,(H2,16,18)/t13-,14-/m0/s1
InChIKeyMBYUEJUBZSXMSJ-KBPBESRZSA-N
XLogP2.10
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2S,3S)-3-phenyl-2,3-dihydro-1H-indole-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2R,3S)-3-phenylaziridine-2-carboxamide
CID 23727454
(2S,3S)-3-(carboxymethyl)-2,3-dihydro-1H-indole-2-carboxylic acid
CID 11666053
3-(2-phenyl-2,3-dihydro-1H-indol-3-yl)propanoic acid
CID 19348216
(6aR,7S,12aR)-7-phenyl-6a,7,12,12a-tetrahydro-5H-quinolino[3,2-c]quinolin-6-one
CID 134962981
3-(trifluoromethoxy)-2,3-dihydro-1H-indole-2-carboxylic acid
CID 174765779
(1S,3S)-1,3-diphenyl-2,3-dihydro-1H-indene-2-carboxylic acid
CID 70130242
dimethyl 2-[(1S,3R,4aS,9S,9aR)-1-methoxy-9-phenyl-1,2,3,4,4a,9,9a,10-octahydroacridin-3-yl]propanedioate
CID 10905969
3-[(E)-3-cyclopropylprop-2-enoyl]-4-phenyl-3,4-dihydro-1H-quinolin-2-one
CID 167131973
(3aS,4S,9bR)-3a,4,5,9b-tetrahydro-3H-cyclopenta[c]quinoline-4-carboxylic acid
CID 6542292
2-phenyl-1,2,3,4-tetrahydroquinolin-4-amine
CID 73425029
(3S,4R)-3-methyl-4-phenyl-1,2,3,4-tetrahydroquinoline
CID 102145962
(6aR,7S,12aR)-7-phenyl-6a,7,12,12a-tetrahydro-6H-chromeno[4,3-b]quinoline
CID 132534994

Frequently Asked Questions

What is the IUPAC name of (2S,3S)-3-phenyl-2,3-dihydro-1H-indole-2-carboxamide?
The IUPAC name of (2S,3S)-3-phenyl-2,3-dihydro-1H-indole-2-carboxamide (CID 100944790) is (2S,3S)-3-phenyl-2,3-dihydro-1H-indole-2-carboxamide.
What is the SMILES notation for (2S,3S)-3-phenyl-2,3-dihydro-1H-indole-2-carboxamide?
The canonical SMILES for (2S,3S)-3-phenyl-2,3-dihydro-1H-indole-2-carboxamide is NC(=O)[C@H]1Nc2ccccc2[C@@H]1c1ccccc1.
What is the InChIKey of (2S,3S)-3-phenyl-2,3-dihydro-1H-indole-2-carboxamide?
The InChIKey is MBYUEJUBZSXMSJ-KBPBESRZSA-N. The full InChI is InChI=1S/C15H14N2O/c16-15(18)14-13(10-6-2-1-3-7-10)11-8-4-5-9-12(11)17-14/h1-9,13-14,17H,(H2,16,18)/t13-,14-/m0/s1.
What are the key properties of (2S,3S)-3-phenyl-2,3-dihydro-1H-indole-2-carboxamide?
(2S,3S)-3-phenyl-2,3-dihydro-1H-indole-2-carboxamide has a molecular weight of 238.29 g/mol, XLogP of 2.10, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3S)-3-phenyl-2,3-dihydro-1H-indole-2-carboxamide is sourced from PubChem (CID 100944790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).